⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11601772 | 0.97 | NPC1 (0.32) | — | |
| SCHEMBL9797589 | 0.94 | — | — | |
| SCHEMBL4554487 | 0.92 | NPC1 (0.32) | — | |
| SCHEMBL3888015 | 0.84 | — | — | |
| SCHEMBL20473699 | 0.84 | — | — | |
| SCHEMBL10572930 | 0.82 | CA1 (0.32) | — | |
| SCHEMBL19953083 | 0.79 | CA1 (0.36) | — | |
| SCHEMBL1322990 | 0.79 | CA1 (0.36) | — | |
| SCHEMBL19952926 | 0.79 | CA1 (0.36) | — | |
| SCHEMBL20473702 | 0.77 | PDGFRB (0.30) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117624415-A | Olefin polymerization system, method and anti-sticking agent used in same | 中国石油天然气股份有限公司 | 2024-03-01 | — | — | CN | claimed |
| CN-117624415-A | Olefin polymerization system, method and anti-sticking agent used in same | 中国石油天然气股份有限公司 | 2024-03-01 | — | — | CN | disclosed |
| CN-106632744-B | Propylene polymerization catalyst, preparation method and application | 北京化工大学 | 2020-05-15 | — | — | CN | disclosed |